[(2R)-butan-2-yl]-[3-(2-chloranyl-4-methyl-phenoxy)propyl]azanium

Systemtic Name: [(2R)-butan-2-yl]-[3-(2-chloranyl-4-methyl-phenoxy)propyl]azanium Openeye Name: 3-(2-chloro-4-methyl-phenoxy)propyl-[(1R)-1-methylpropyl]ammonium CAS Name: [(2R)-butan-2-yl]-[3-(2-chloro-4-methylphenoxy)propyl]ammonium IUPAC Name: [(2R)-butan-2-yl]-[3-(2-chloro-4-methylphenoxy)propyl]azanium Traditional Name: 3-(2-chloro-4-methyl-phenoxy)propyl-[(1R)-1-methylpropyl]ammonium Formula: C14H23ClNO+ MolecularWeight: 256.79152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCCOC1=C(C=C(C=C1)C)Cl

Isomeric SMILES

CC[C@@H](C)[NH2+]CCCOC1=C(C=C(C=C1)C)Cl

InChI

InChI=1S/C14H22ClNO/c1-4-12(3)16-8-5-9-17-14-7-6-11(2)10-13(14)15/h6-7,10,12,16H,4-5,8-9H2,1-3H3/p+1/t12-/m1/s1